SCHEMBL19807634

SCHEMBL19807634

CC1Cc2sc(NC(=O)Nc3ccc(Cl)cc3)c(C(N)=O)c2C1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 12/20 0.61
CYP3A4 P08684 2/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
TNIK Q9UKE5 1/20 0.54
MAPT P10636 2/20 0.49
DUSP3 P51452 1/20 0.49
PTPN5 P54829 1/20 0.49
PTPN11 Q06124 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
EPHB4 P54760 1/20 0.48
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
ATM Q13315 1/20 0.48
TNF P01375 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17022001 0.82 KCNH2 (0.58) KCNH2CYP3A4CYP2C9CYP2C19TNIK
SCHEMBL17018729 0.81 TNIK (0.59) KCNH2CYP3A4CYP2C9CYP2C19TNIK
SCHEMBL18220897 0.81 TNIK (0.59) KCNH2CYP3A4CYP2C9CYP2C19TNIK
SCHEMBL5455094 0.80 TNIK (0.64) TNIKMAPTDUSP3PTPN5PTPN11
Iodide SCHEMBL17006355 0.80 TNIK (0.58) KCNH2CYP3A4CYP2C9CYP2C19TNIK
Hydrochloric Acid SCHEMBL17006353 0.80 KCNH2 (0.59) KCNH2CYP3A4CYP2C9CYP2C19TNIK
SCHEMBL18015730 0.80 KCNH2 (0.71) KCNH2MAPTMEN1KMT2ANPC1
SCHEMBL4234573 0.80 FLT3 (0.72) KCNH2CYP2C19MAPTMEN1KMT2A
SCHEMBL21322502 0.78 KCNH2 (0.59) KCNH2CYP3A4CYP2C9CYP2C19TNIK
SCHEMBL18220909 0.78 TNIK (0.55) KCNH2CYP3A4CYP2C9CYP2C19TNIK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399994-B2 Compounds and methods for preventing or treating sensory hair cell death UNIVERSITY OF WASHINGTON (US) 2019-09-03 US disclosed
US-20180022756-A1 COMPOUNDS AND METHODS FOR PREVENTING OR TREATING SENSORY HAIR CELL DEATH FRED HUTCHINSON CANCER CENTER 2018-01-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10399994-B2 Compounds and methods for preventing or treating sensory hair cell death CASP3, AIFM1, ATP6V1B1 KCNH2 1453/4885CYP3A4 4809/4885CYP2C9 4564/4885
US-20180022756-A1 COMPOUNDS AND METHODS FOR PREVENTING OR TREATING SENSORY HAIR CELL DEATH CASP3, AIFM1, ATP6V1B1 KCNH2 1453/4885CYP3A4 4809/4885CYP2C9 4564/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.